MMs03133972 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0042 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9000 -1.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2463 1.3054 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0463 1.3054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7463 1.3096 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7537 -1.2884 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2537 -1.2927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5073 -2.5938 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4926 2.6108 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3412 1.7623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8787 3.9794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9905 4.9862 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8391 5.8347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2917 4.2399 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1402 3.3914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9840 2.7718 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6603 4.8539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8763 3.9756 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2449 4.5896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3975 6.0818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4609 3.7113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3083 2.2191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5243 1.3409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8929 1.9549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0455 3.4471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8295 4.3253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8295 6.4775 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4575 7.0838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2465 6.1987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2965 8.5751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5075 9.4602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3465 10.9515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9745 11.5578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7634 10.6727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9245 9.1813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4927 2.6023 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0034 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0034 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3566 -2.3260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8411 3.3764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1706 4.9482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9864 5.8468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5211 5.6899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2134 1.7279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4023 0.1471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8657 1.2523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1404 3.9383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9515 5.5191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6051 8.9752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3153 11.6596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8457 12.7508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6658 11.1577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9556 8.4733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2927 2.5989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 39 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 10 11 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 30 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 38 2 0 0 0 0 34 35 2 0 0 0 0 34 53 1 0 0 0 0 35 36 1 0 0 0 0 35 54 1 0 0 0 0 36 37 2 0 0 0 0 36 55 1 0 0 0 0 37 38 1 0 0 0 0 37 56 1 0 0 0 0 38 57 1 0 0 0 0 39 58 1 0 0 0 0 M END